4-[2-[3-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]phenyl]ethanoylamino]benzenesulfonyl fluoride

Systemtic Name: 4-[2-[3-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]phenyl]ethanoylamino]benzenesulfonyl fluoride Openeye Name: 4-[[2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]acetyl]amino]benzenesulfonyl fluoride CAS Name: 4-[[2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-1-oxoethyl]amino]benzenesulfonyl fluoride IUPAC Name: 4-[[2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]acetyl]amino]benzenesulfonyl fluoride Traditional Name: 4-[[2-[3-(4,6-diamino-2,2-dimethyl-s-triazin-1-yl)phenyl]acetyl]amino]benzenesulfonyl fluoride Formula: C19H21FN6O3S MolecularWeight: 432.471843

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC=CC(=C2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)F)N)N)C

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC=CC(=C2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)F)N)N)C

InChI

InChI=1S/C19H21FN6O3S/c1-19(2)25-17(21)24-18(22)26(19)14-5-3-4-12(10-14)11-16(27)23-13-6-8-15(9-7-13)30(20,28)29/h3-10H,11H2,1-2H3,(H,23,27)(H4,21,22,24,25)